6-[1-(ethylamino)propyl]-N-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-3-amine

C16H24N4S — CID 115939493

About 6-[1-(ethylamino)propyl]-N-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-3-amine

6-[1-(ethylamino)propyl]-N-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-3-amine (PubChem CID 115939493) has the molecular formula C16H24N4S and a molecular weight of 304.46 g/mol. Its IUPAC name is 6-[1-(ethylamino)propyl]-N-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-3-amine.

Molecular Properties

• Compound Name: 6-[1-(ethylamino)propyl]-N-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-3-amine
• PubChem CID: 115939493
• Molecular Formula: C16H24N4S
• Molecular Weight: 304.46 g/mol
• Exact Mass: 304.17
• IUPAC Name: 6-[1-(ethylamino)propyl]-N-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-3-amine
• SMILES: CCNC(CC)c1ccc(N(C)Cc2csc(C)n2)cn1
• InChI: InChI=1S/C16H24N4S/c1-5-15(17-6-2)16-8-7-14(9-18-16)20(4)10-13-11-21-12(3)19-13/h7-9,11,15,17H,5-6,10H2,1-4H3
• InChIKey: BZHHAYJREKZDMU-UHFFFAOYSA-N
• XLogP: 3.54
• TPSA: 41.05 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 7
• Heavy Atoms: 21
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	304.46
LogP ≤ 5	3.54
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 6-[1-(ethylamino)propyl]-N-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-3-amine?

The IUPAC name of 6-[1-(ethylamino)propyl]-N-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-3-amine (CID 115939493) is 6-[1-(ethylamino)propyl]-N-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-3-amine.

What is the SMILES notation for 6-[1-(ethylamino)propyl]-N-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-3-amine?

The canonical SMILES for 6-[1-(ethylamino)propyl]-N-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-3-amine is CCNC(CC)c1ccc(N(C)Cc2csc(C)n2)cn1.

What is the InChIKey of 6-[1-(ethylamino)propyl]-N-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-3-amine?

The InChIKey is BZHHAYJREKZDMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4S/c1-5-15(17-6-2)16-8-7-14(9-18-16)20(4)10-13-11-21-12(3)19-13/h7-9,11,15,17H,5-6,10H2,1-4H3.

What are the key properties of 6-[1-(ethylamino)propyl]-N-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-3-amine?

6-[1-(ethylamino)propyl]-N-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-3-amine has a molecular weight of 304.46 g/mol, XLogP of 3.54, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 6-[1-(ethylamino)propyl]-N-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-3-amine is sourced from PubChem (CID 115939493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).